Molecule

ID:46318

General Information
Structure
MolImage
Molecular Formula
C₇H₁₅ClFNO
Molecular Mass
183.6515032
Exact Mass
183.08262001
Charge
0
InChI
InChI=1S/C7H14FNO.ClH/c8-2-4-10-6-7-1-3-9-5-7;/h7,9H,1-6H2;1H
InChIKey
IRESZZKVFRUYOS-UHFFFAOYSA-N
Canonic Smiles
FCCOCC1CNCC1.Cl
Isomeric Smiles
N1CC(COCCF)CC1.Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
1
LogD (pH = 5.5)
-3.2135918
LogD (pH = 7.4)
-3.106982
Log P
0.026886197
Molar Refractivity
37.8873
Polarizability
14.835585
Polar Surface Area
21.26
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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